2-(1H-benzimidazol-2-yl)-3-(2-butoxyphenyl)prop-2-enenitrile
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-3-(2-butoxyphenyl)prop-2-enenitrile
2-(1H-benzimidazol-2-yl)-3-(2-butoxyphenyl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 3448-2128 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-3-(2-butoxyphenyl)prop-2-enenitrile |
| Molecular Weight: | 317.39 |
| Molecular Formula: | C20 H19 N3 O |
| Smiles: | CCCCOc1ccccc1/C=C(C#N)/c1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 5.2678 |
| logD: | 5.2669 |
| logSw: | -5.2357 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.819 |
| InChI Key: | PGPWUGSOVHJLIQ-UHFFFAOYSA-N |